Chemical ID: 3843641

CCSc1nnc(n1c2ccc(cc2)C)c3ccccc3OC
Chemical ID:
3843641
Name [?]:
3-ethylsulfanyl-5-(2-methoxyphenyl)-4-(p-tolyl)-1,2,4-triazole
SMILES [?]:
CCSc1nnc(n1c2ccc(cc2)C)c3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H19N3OS
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.3404
Area:528.136
Solvation:-2.86296
Coulombic:-22.1181
Bond Count [?]
All:25
Single:17
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:325.429
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:6.33
LogP (Chemaxon):4.4

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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